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BDBM50204592 6-(3-methoxy-4-(2-(piperidin-1-yl)ethoxy)phenyl)-5-phenyl-N-(2-(piperazin-1-yl)ethyl)furo[2,3-d]pyrimidin-4-amine::CHEMBL394490

SMILES: COc1cc(ccc1OCCN1CCCCC1)-c1oc2ncnc(NCCN3CCNCC3)c2c1-c1ccccc1

InChI Key: InChIKey=PQXQJSMNKNNINY-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50204592   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50204592
PNG
(6-(3-methoxy-4-(2-(piperidin-1-yl)ethoxy)phenyl)-5...)
Show SMILES COc1cc(ccc1OCCN1CCCCC1)-c1oc2ncnc(NCCN3CCNCC3)c2c1-c1ccccc1
Show InChI InChI=1S/C32H40N6O3/c1-39-27-22-25(10-11-26(27)40-21-20-37-15-6-3-7-16-37)30-28(24-8-4-2-5-9-24)29-31(35-23-36-32(29)41-30)34-14-19-38-17-12-33-13-18-38/h2,4-5,8-11,22-23,33H,3,6-7,12-21H2,1H3,(H,34,35,36)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 22n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Lck


Bioorg Med Chem Lett 17: 2305-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.057
BindingDB Entry DOI: 10.7270/Q2697365
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM50204592
PNG
(6-(3-methoxy-4-(2-(piperidin-1-yl)ethoxy)phenyl)-5...)
Show SMILES COc1cc(ccc1OCCN1CCCCC1)-c1oc2ncnc(NCCN3CCNCC3)c2c1-c1ccccc1
Show InChI InChI=1S/C32H40N6O3/c1-39-27-22-25(10-11-26(27)40-21-20-37-15-6-3-7-16-37)30-28(24-8-4-2-5-9-24)29-31(35-23-36-32(29)41-30)34-14-19-38-17-12-33-13-18-38/h2,4-5,8-11,22-23,33H,3,6-7,12-21H2,1H3,(H,34,35,36)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 586n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Ack1


Bioorg Med Chem Lett 17: 2305-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.057
BindingDB Entry DOI: 10.7270/Q2697365
More data for this
Ligand-Target Pair